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Ligand

Name1-Propylxanthine
Molecular formulaC8H10N4O2
IUPAC name1-propyl-3,7-dihydropurine-2,6-dione
Molecular weight194.194
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP0.6
Synonyms1-propyl-3,7-dihydropurine-2,6-dione
BDBM50001490
SCHEMBL8930198
1H-Purine-2,6-dione, 3,7-dihydro-1-propyl-
CTK4A2909
[ Show all ]
Inchi KeyIWBONKMODGBEOX-UHFFFAOYSA-N
Inchi IDInChI=1S/C8H10N4O2/c1-2-3-12-7(13)5-6(10-4-9-5)11-8(12)14/h4H,2-3H2,1H3,(H,9,10)(H,11,14)
PubChem CID128525
ChEMBLCHEMBL39986
IUPHARN/A
BindingDB50001490
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 8
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
143178Adenosine receptor A1P47745ADORA1Cavia porcellus (Guinea pig)326
143179Adenosine receptor A1P25099Adora1Rattus norvegicus (Rat)326
143180Adenosine receptor A2aP30543Adora2aRattus norvegicus (Rat)410
143182Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
143184Adenosine receptor A2aP46616ADORA2ACavia porcellus (Guinea pig)409
143181Adenosine receptor A2bP29276Adora2bRattus norvegicus (Rat)332
143183Adenosine receptor A2bP29275ADORA2BHomo sapiens (Human)332
143185Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318

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